Vitas-M small molecule compound
(12aS)-6-(2,4-dimethoxyphenyl)-2-hexyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL536961
SMILES CCCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2OC)OC)[nH]c2c1cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H33N3O4 MW 475.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N3O4/c1-4-5-6-9-14-30-17-25(32)31-23(28(30)33)16-21-19-10-7-8-11-22(19)29-26(21)27(31)20-13-12-18(34-2)15-24(20)35-3/h7-8,10-13,15,23,27,29H,4-6,9,14,16-17H2,1-3H3/t23-,27?/m0/s1InChIKey
NODIPXZRMXTNTH-DCCUJTHKSA-NSynonyms
956939-27-8(12aS)6(24dimethoxyphenyl)2hexyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(24dimethoxyphenyl)2hexyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))2(24dimethoxyphenyl)6hexyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399360
956939278
CCCCCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccc(cc2OC)OC)(nH)c2c1cccc2
InChI=1SC28H33N3O4c1456914301725(32)3123(28(30)33)16211910781122(19)2926(21)27(31)20131218(342)1524(20)353h78101315232729H469141617H213H3t2327?m0s1
MFCD04143147
ZINC000002098633
ZINC000002098634
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